#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g0b n SER 0 N 0.00 0.00 -0.00 1.61 3.41 -1.26 -4.63 113.62 112.75 2g0b n SER 0 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.63 2g0b n SER 0 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 2g0b n SER 0 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 2g0b n MET 1 N 0.00 3.78 -3.14 4.33 0.00 -1.26 -4.63 117.12 116.21 2g0b n MET 1 Ca 0.00 -0.01 -0.20 0.00 -0.00 0.00 0.00 57.70 57.49 2g0b n MET 1 Cb 0.00 -0.82 -0.03 0.00 0.00 0.00 0.00 33.22 32.36 2g0b n MET 1 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 2g0b n THR 2 N -1.28 0.53 -1.80 1.12 -2.24 -1.26 -5.14 114.28 104.21 2g0b n THR 2 Ca 0.00 -4.80 -0.32 0.00 -2.27 0.00 0.00 64.05 56.67 2g0b n THR 2 Cb 0.07 -0.55 0.03 0.00 -2.10 0.00 0.00 70.33 67.78 2g0b n THR 2 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2g0b s PRO 3 N -2.63 3.11 -0.38 -0.78 0.02 -1.26 -4.90 135.00 128.18 2g0b s PRO 3 Ca 0.42 1.09 0.05 0.00 0.02 0.00 0.00 61.00 62.58 2g0b s PRO 3 Cb 0.33 -2.01 0.16 0.00 0.02 0.00 0.00 34.50 33.00 2g0b s PRO 3 CO -0.09 -0.97 0.45 0.50 -0.33 0.00 0.00 177.00 176.56 2g0b s ARG 4 N -4.54 0.69 -0.23 5.54 3.52 -1.26 -5.02 118.95 117.65 2g0b s ARG 4 Ca 0.61 -0.64 -0.09 0.00 -0.13 0.00 0.00 55.73 55.49 2g0b s ARG 4 Cb -0.15 -0.46 -0.04 0.00 -1.56 0.00 0.00 34.95 32.74 2g0b s ARG 4 CO 0.46 -1.19 0.11 0.15 -0.81 0.00 0.00 175.30 174.02 2g0b s LYS 5 N 1.61 3.90 -0.17 5.12 -0.14 -1.26 -0.98 119.74 127.82 2g0b s LYS 5 Ca 0.16 -0.36 -0.00 0.00 -1.36 0.00 0.00 55.97 54.41 2g0b s LYS 5 Cb -0.12 -3.40 0.00 0.00 -1.68 0.00 0.00 37.83 32.63 2g0b s LYS 5 CO -0.06 0.01 -0.14 0.08 -0.76 0.00 0.00 175.35 174.48 2g0b s VAL 6 N 1.14 2.64 -0.21 3.17 1.01 0.06 -4.94 120.40 123.27 2g0b s VAL 6 Ca 0.06 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 2g0b s VAL 6 Cb -0.14 -2.13 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 2g0b s VAL 6 CO 0.04 0.50 -0.02 0.00 0.00 0.00 0.00 175.10 175.63 2g0b s ALA 7 N 1.07 2.93 0.22 5.51 0.00 -1.26 0.17 121.76 130.41 2g0b s ALA 7 Ca -0.00 -1.05 -0.12 0.00 0.00 0.00 0.00 51.96 50.78 2g0b s ALA 7 Cb -0.14 -1.73 -0.00 0.00 0.00 0.00 0.00 23.12 21.24 2g0b s ALA 7 CO -0.04 -0.24 0.43 -0.98 0.00 0.00 0.00 175.76 174.93 2g0b s ARG 8 N 1.16 1.44 0.15 0.00 1.70 -0.81 -4.99 118.95 117.61 2g0b s ARG 8 Ca 0.02 -1.22 -0.30 0.00 -0.47 0.00 0.00 55.73 53.76 2g0b s ARG 8 Cb -0.14 0.45 -0.08 0.00 -0.57 0.00 0.00 34.95 34.61 2g0b s ARG 8 CO 0.00 -0.58 1.26 0.42 -1.08 0.00 0.00 175.30 175.32 2g0b s ILE 9 N -4.00 3.52 -0.24 4.99 1.01 -1.26 -0.66 121.20 124.56 2g0b s ILE 9 Ca 0.21 1.20 -0.24 0.00 0.00 0.00 0.00 60.65 61.82 2g0b s ILE 9 Cb 0.00 -3.77 -0.01 0.00 0.01 0.00 0.00 42.46 38.70 2g0b s ILE 9 CO 0.06 0.15 0.80 -0.76 0.00 0.00 0.00 174.94 175.19 2g0b s LEU 10 N 0.28 4.08 -0.04 2.97 1.43 0.71 -4.86 118.68 123.26 2g0b s LEU 10 Ca 0.57 0.99 -0.01 0.00 -1.03 0.00 0.00 54.13 54.65 2g0b s LEU 10 Cb -0.34 -3.14 -0.02 0.00 0.03 0.00 0.00 46.19 42.72 2g0b s LEU 10 CO 0.34 -0.49 -0.05 0.52 0.23 0.00 0.00 176.35 176.91 2g0b n VAL 11 N 5.21 0.23 -2.20 -1.59 0.31 -1.26 -4.67 118.33 114.36 2g0b n VAL 11 Ca 0.05 -0.07 -0.41 0.00 -0.01 0.00 0.00 64.34 63.89 2g0b n VAL 11 Cb 0.48 -1.16 -0.03 0.00 -0.91 0.00 0.00 33.84 32.21 2g0b n VAL 11 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2g0b s ALA 12 N -2.08 3.52 0.45 3.52 0.00 -1.26 -4.93 121.76 120.98 2g0b s ALA 12 Ca -0.06 1.13 0.22 0.00 0.00 0.00 0.00 51.96 53.26 2g0b s ALA 12 Cb 0.02 -3.48 1.22 0.00 0.00 0.00 0.00 23.12 20.87 2g0b s ALA 12 CO 0.08 -0.55 1.84 -1.35 0.00 0.00 0.00 175.76 175.78 2g0b h PRO 13 N 5.03 0.27 0.00 0.00 0.11 -1.99 -0.64 132.00 134.78 2g0b h PRO 13 Ca -0.45 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 2g0b h PRO 13 Cb 1.22 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2g0b h PRO 13 CO 0.75 0.18 -0.43 -2.95 -0.21 0.00 0.00 178.00 175.34 2g0b h ASN 14 N 0.28 0.00 0.25 -2.05 -1.07 -1.99 -1.96 115.58 109.04 2g0b h ASN 14 Ca 0.50 0.00 -0.21 0.00 0.07 0.00 0.00 56.30 56.66 2g0b h ASN 14 Cb 1.46 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.71 2g0b h ASN 14 CO -0.15 0.43 -0.85 -0.33 0.07 0.00 0.00 177.43 176.60 2g0b h GLU 15 N 0.00 0.45 -0.01 4.14 5.08 -1.51 -2.40 114.58 120.33 2g0b h GLU 15 Ca -0.00 -0.43 -0.18 0.00 -1.00 0.00 0.00 59.36 57.75 2g0b h GLU 15 Cb 1.02 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 2g0b h GLU 15 CO 0.06 1.07 -0.79 0.00 -1.00 0.00 0.00 179.01 178.35 2g0b h ARG 16 N 0.28 0.17 -0.57 2.33 3.08 -1.39 -1.03 114.38 117.25 2g0b h ARG 16 Ca -0.06 -0.17 -0.08 0.00 0.07 0.00 0.00 59.98 59.74 2g0b h ARG 16 Cb 1.46 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.53 2g0b h ARG 16 CO 0.15 0.88 0.05 -0.44 -1.07 0.00 0.00 179.97 179.54 2g0b h ASP 17 N 0.11 0.94 -0.02 7.04 3.32 -1.38 -1.46 116.42 124.96 2g0b h ASP 17 Ca -0.03 -0.28 -0.11 0.00 0.02 0.00 0.00 57.03 56.63 2g0b h ASP 17 Cb 1.38 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.67 2g0b h ASP 17 CO 0.12 0.99 -0.31 0.00 -1.72 0.00 0.00 179.24 178.32 2g0b h ALA 18 N 0.99 1.02 -0.36 3.45 0.00 -1.30 -1.28 119.26 121.77 2g0b h ALA 18 Ca 0.17 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 2g0b h ALA 18 Cb 0.48 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2g0b h ALA 18 CO 0.02 0.59 0.07 0.00 0.00 0.00 0.00 179.25 179.93 2g0b h ALA 19 N 1.25 0.48 -0.27 0.00 0.00 -1.01 -2.06 119.26 117.65 2g0b h ALA 19 Ca 0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2g0b h ALA 19 Cb 0.76 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2g0b h ALA 19 CO 0.06 0.17 0.07 -0.09 0.00 0.00 0.00 179.25 179.46 2g0b h ARG 20 N 0.44 0.39 -0.53 0.00 2.43 -1.02 -2.14 114.38 113.94 2g0b h ARG 20 Ca 0.11 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.11 2g0b h ARG 20 Cb 0.34 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 2g0b h ARG 20 CO 0.00 0.36 -0.13 -0.09 -1.51 0.00 0.00 179.97 178.60 2g0b h ARG 21 N 0.39 1.03 -0.14 0.20 1.12 -0.95 0.19 114.38 116.22 2g0b h ARG 21 Ca 0.09 -0.40 -0.01 0.00 -1.11 0.00 0.00 59.98 58.56 2g0b h ARG 21 Cb 0.15 -0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.04 2g0b h ARG 21 CO -0.00 1.09 0.06 0.82 -3.11 0.00 0.00 179.97 178.82 2g0b h ILE 22 N 0.91 1.15 -0.75 1.20 2.04 -0.98 -1.34 117.51 119.74 2g0b h ILE 22 Ca 0.13 -0.44 0.03 0.00 1.00 0.00 0.00 64.86 65.58 2g0b h ILE 22 Cb 0.71 1.19 -0.05 0.00 -0.74 0.00 0.00 36.82 37.94 2g0b h ILE 22 CO 0.05 0.14 0.47 0.58 0.00 0.00 0.00 178.15 179.39 2g0b h VAL 23 N 0.07 1.11 -0.30 1.67 2.07 -1.27 -0.17 116.25 119.43 2g0b h VAL 23 Ca 0.05 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 2g0b h VAL 23 Cb 0.16 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 2g0b h VAL 23 CO -0.00 0.17 0.15 -0.09 0.02 0.00 0.00 177.57 177.81 2g0b h ARG 24 N 0.93 0.42 -0.30 1.57 2.43 -0.83 -1.52 114.38 117.08 2g0b h ARG 24 Ca 0.30 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 59.27 2g0b h ARG 24 Cb 0.01 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.48 2g0b h ARG 24 CO -0.11 0.40 -0.36 1.15 -1.51 0.00 0.00 179.97 179.53 2g0b h THR 25 N 0.35 1.29 -0.43 0.20 2.02 -0.80 -2.13 112.91 113.42 2g0b h THR 25 Ca 0.10 -1.54 -0.02 0.00 0.77 0.00 0.00 66.41 65.72 2g0b h THR 25 Cb 0.11 1.59 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 2g0b h THR 25 CO -0.01 0.50 0.19 0.74 0.37 0.00 0.00 175.52 177.30 2g0b h THR 26 N 0.53 1.19 -0.10 3.16 2.02 -1.01 -1.89 112.91 116.81 2g0b h THR 26 Ca 0.04 -0.57 -0.15 0.00 0.77 0.00 0.00 66.41 66.50 2g0b h THR 26 Cb 0.95 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 2g0b h THR 26 CO 0.09 0.21 -0.59 1.88 0.37 0.00 0.00 175.52 177.47 2g0b h TYR 27 N 0.54 0.42 -0.01 3.16 -1.99 -1.27 -2.21 116.97 115.62 2g0b h TYR 27 Ca 0.14 -0.16 -0.12 0.00 2.00 0.00 0.00 58.73 60.60 2g0b h TYR 27 Cb 0.16 -0.08 -0.02 0.00 2.00 0.00 0.00 36.73 38.80 2g0b h TYR 27 CO -0.00 0.84 -0.55 0.93 -0.00 0.00 0.00 178.16 179.37 2g0b h GLU 28 N 0.24 0.03 0.00 4.88 5.08 -1.29 0.84 114.58 124.37 2g0b h GLU 28 Ca -0.00 -0.02 -0.20 0.00 -1.00 0.00 0.00 59.36 58.14 2g0b h GLU 28 Cb 1.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 2g0b h GLU 28 CO 0.10 0.57 -0.88 0.00 -1.00 0.00 0.00 179.01 177.80 2g0b h ALA 29 N 1.42 0.50 -0.01 3.43 0.00 -1.08 -3.12 119.26 120.39 2g0b h ALA 29 Ca -0.00 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.19 2g0b h ALA 29 Cb 0.98 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2g0b h ALA 29 CO 0.07 0.89 -0.09 1.04 0.00 0.00 0.00 179.25 181.16 2g0b n GLN 30 N -3.68 1.43 -1.23 0.00 6.02 -0.85 -4.95 117.38 114.11 2g0b n GLN 30 Ca -0.04 -0.87 -0.00 0.00 -0.01 0.00 0.00 57.00 56.08 2g0b n GLN 30 Cb 0.81 -1.48 -0.00 0.00 1.02 0.00 0.00 30.24 30.58 2g0b n GLN 30 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2g0b n GLY 31 N 1.24 0.39 3.83 1.08 0.00 -0.43 -5.05 105.19 106.25 2g0b n GLY 31 Ca 0.16 -1.04 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 2g0b n GLY 31 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2g0b s TYR 32 N -2.01 3.51 0.17 1.61 4.12 0.28 -4.94 117.35 120.10 2g0b s TYR 32 Ca 0.00 1.27 -0.26 0.00 0.02 0.00 0.00 57.07 58.10 2g0b s TYR 32 Cb 0.00 -2.55 -0.08 0.00 -1.52 0.00 0.00 41.96 37.81 2g0b s TYR 32 CO 0.00 0.23 0.79 0.00 0.02 0.00 0.00 175.55 176.59 2g0b s ALA 33 N -1.74 3.44 -0.32 3.71 0.00 0.53 -4.05 121.76 123.32 2g0b s ALA 33 Ca 0.48 0.38 -0.16 0.00 0.00 0.00 0.00 51.96 52.66 2g0b s ALA 33 Cb -0.13 -2.98 -0.02 0.00 0.00 0.00 0.00 23.12 19.99 2g0b s ALA 33 CO 0.19 0.28 0.41 0.96 0.00 0.00 0.00 175.76 177.60 2g0b s ILE 34 N -1.11 5.13 -0.03 0.00 -4.36 -1.26 -4.51 121.20 115.06 2g0b s ILE 34 Ca 0.36 0.30 0.00 0.00 -0.26 0.00 0.00 60.65 61.05 2g0b s ILE 34 Cb -0.23 -3.82 -0.04 0.00 1.25 0.00 0.00 42.46 39.62 2g0b s ILE 34 CO 0.27 -0.05 0.02 -0.62 0.24 0.00 0.00 174.94 174.80 2g0b s ASP 35 N 1.71 5.27 0.00 4.36 -1.08 -1.26 -5.01 116.67 120.65 2g0b s ASP 35 Ca 0.15 0.07 0.25 0.00 -0.52 0.00 0.00 52.55 52.49 2g0b s ASP 35 Cb -0.16 -1.44 1.11 0.00 -1.46 0.00 0.00 42.92 40.97 2g0b s ASP 35 CO 0.12 0.31 1.80 -0.62 0.52 0.00 0.00 175.17 177.29 2g0b n GLU 36 N 1.56 0.10 0.02 4.34 1.02 -1.26 -3.25 120.64 123.17 2g0b n GLU 36 Ca -0.15 0.07 -0.02 0.00 -0.02 0.00 0.00 57.16 57.04 2g0b n GLU 36 Cb 0.53 -1.50 0.24 0.00 -0.02 0.00 0.00 31.44 30.69 2g0b n GLU 36 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2g0b h SER 37 N 0.00 0.45 -0.42 1.62 4.64 -2.00 -2.63 113.55 115.22 2g0b h SER 37 Ca 0.00 -0.13 -0.13 0.00 -0.47 0.00 0.00 61.79 61.06 2g0b h SER 37 Cb 0.37 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 2g0b h SER 37 CO 0.00 0.66 -0.24 -0.26 -0.87 0.00 0.00 176.83 176.12 2g0b h PHE 38 N 0.42 1.04 -0.62 4.77 -1.00 -2.00 -2.18 116.94 117.37 2g0b h PHE 38 Ca 0.07 -0.27 -0.06 0.00 2.81 0.00 0.00 57.97 60.52 2g0b h PHE 38 Cb 0.57 -0.24 -0.03 0.00 3.61 0.00 0.00 35.95 39.87 2g0b h PHE 38 CO 0.02 1.06 0.13 0.00 -1.61 0.00 0.00 178.31 177.91 2g0b h ALA 39 N 0.82 1.07 0.15 2.45 0.00 -1.73 -2.53 119.26 119.49 2g0b h ALA 39 Ca 0.09 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2g0b h ALA 39 Cb 0.81 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2g0b h ALA 39 CO 0.07 0.61 -0.15 1.15 0.00 0.00 0.00 179.25 180.93 2g0b h THR 40 N 0.93 0.66 -0.81 0.00 2.02 -1.26 -2.48 112.91 111.97 2g0b h THR 40 Ca 0.20 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.48 2g0b h THR 40 Cb 0.36 0.66 -0.08 0.00 -1.74 0.00 0.00 68.15 67.35 2g0b h THR 40 CO 0.00 0.00 0.45 -0.26 0.37 0.00 0.00 175.52 176.08 2g0b h PHE 41 N -0.33 0.81 -0.07 3.16 -1.00 -1.32 -2.81 116.94 115.38 2g0b h PHE 41 Ca 0.00 0.03 -0.10 0.00 2.81 0.00 0.00 57.97 60.72 2g0b h PHE 41 Cb 0.32 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.62 2g0b h PHE 41 CO -0.13 0.30 -0.40 -0.07 -1.61 0.00 0.00 178.31 176.40 2g0b h LEU 42 N 0.73 0.16 -1.19 1.54 3.38 -1.08 -1.29 115.31 117.57 2g0b h LEU 42 Ca 0.40 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.31 2g0b h LEU 42 Cb 0.42 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2g0b h LEU 42 CO -0.27 0.55 0.00 -1.84 0.09 0.00 0.00 178.44 176.97 2g0b n GLU 43 N -4.04 1.77 -2.07 1.13 0.28 -0.97 -4.73 120.64 112.00 2g0b n GLU 43 Ca -0.02 -1.17 -0.28 0.00 -0.16 0.00 0.00 57.16 55.53 2g0b n GLU 43 Cb 0.46 -1.34 0.07 0.00 1.43 0.00 0.00 31.44 32.05 2g0b n GLU 43 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2g0b s GLY 44 N -1.32 1.63 0.20 -1.84 0.00 -0.49 -5.01 107.32 100.50 2g0b s GLY 44 Ca 0.29 -0.71 -0.09 0.00 0.00 0.00 0.00 44.72 44.21 2g0b s GLY 44 CO 0.22 -0.30 1.73 -2.55 0.00 0.00 0.00 173.10 172.21 2g0b h PRO 45 N -0.71 1.13 -0.41 2.90 0.11 -1.91 -3.15 132.00 129.97 2g0b h PRO 45 Ca -0.45 -0.25 0.00 0.00 0.11 0.00 0.00 66.00 65.41 2g0b h PRO 45 Cb 1.30 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2g0b h PRO 45 CO 0.63 0.97 0.00 -1.13 -0.21 0.00 0.00 178.00 178.26 2g0b n SER 46 N -4.27 1.51 -4.66 -2.05 3.41 -1.26 -4.87 113.62 101.44 2g0b n SER 46 Ca 0.06 -2.08 -0.24 0.00 -0.26 0.00 0.00 58.87 56.34 2g0b n SER 46 Cb 0.23 -0.26 -0.07 0.00 -0.26 0.00 0.00 64.21 63.84 2g0b n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2g0b s ALA 47 N -1.65 3.18 -0.13 7.33 0.00 -1.19 0.41 121.76 129.70 2g0b s ALA 47 Ca 0.15 -1.52 -0.06 0.00 0.00 0.00 0.00 51.96 50.52 2g0b s ALA 47 Cb 0.09 -0.88 0.06 0.00 0.00 0.00 0.00 23.12 22.38 2g0b s ALA 47 CO 0.08 0.36 0.30 0.99 0.00 0.00 0.00 175.76 177.49 2g0b s THR 48 N -2.05 -0.18 -0.16 0.00 2.01 -0.50 -4.96 115.64 109.80 2g0b s THR 48 Ca 0.29 0.17 -0.05 0.00 0.31 0.00 0.00 61.69 62.42 2g0b s THR 48 Cb -0.08 -0.48 -0.03 0.00 0.01 0.00 0.00 72.50 71.93 2g0b s THR 48 CO 0.19 0.07 -0.01 -0.89 -0.69 0.00 0.00 174.62 173.30 2g0b s THR 49 N 1.70 4.17 0.23 -0.82 2.01 -1.26 -1.18 115.64 120.49 2g0b s THR 49 Ca -0.06 -0.26 0.07 0.00 0.31 0.00 0.00 61.69 61.74 2g0b s THR 49 Cb -0.10 -2.84 -0.04 0.00 0.01 0.00 0.00 72.50 69.53 2g0b s THR 49 CO -0.10 0.49 0.19 -0.36 -0.69 0.00 0.00 174.62 174.15 2g0b s PHE 50 N 0.27 3.13 0.06 4.92 0.08 0.16 -0.20 117.98 126.40 2g0b s PHE 50 Ca -0.01 -0.09 -0.00 0.00 0.12 0.00 0.00 56.93 56.95 2g0b s PHE 50 Cb -0.13 -1.43 -0.04 0.00 -0.57 0.00 0.00 43.02 40.84 2g0b s PHE 50 CO 0.02 0.52 -0.04 0.20 -0.10 0.00 0.00 175.22 175.82 2g0b s GLY 51 N -3.68 0.54 -0.09 4.36 0.00 0.16 -2.22 107.32 106.39 2g0b s GLY 51 Ca 0.32 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 43.82 2g0b s GLY 51 CO 0.25 -1.33 -0.08 -2.27 0.00 0.00 0.00 173.10 169.66 2g0b s LEU 52 N -2.90 1.26 -0.13 0.66 2.96 0.15 -1.92 118.68 118.75 2g0b s LEU 52 Ca 0.07 -0.27 0.00 0.00 -0.22 0.00 0.00 54.13 53.71 2g0b s LEU 52 Cb 0.07 -0.78 -0.01 0.00 0.50 0.00 0.00 46.19 45.96 2g0b s LEU 52 CO -0.08 -0.09 -0.14 -0.36 -1.32 0.00 0.00 176.35 174.36 2g0b s PHE 53 N 1.43 2.78 -0.80 5.38 0.40 0.13 -0.55 117.98 126.75 2g0b s PHE 53 Ca -0.01 -0.73 -0.18 0.00 -0.60 0.00 0.00 56.93 55.42 2g0b s PHE 53 Cb -0.13 -1.84 0.15 0.00 0.51 0.00 0.00 43.02 41.70 2g0b s PHE 53 CO -0.05 -0.26 0.91 1.21 0.70 0.00 0.00 175.22 177.73 2g0b s ASN 54 N 0.41 6.53 -1.33 1.36 3.84 0.86 -0.76 114.94 125.84 2g0b s ASN 54 Ca -0.11 -2.02 -0.01 0.00 0.21 0.00 0.00 52.86 50.93 2g0b s ASN 54 Cb -0.16 -2.32 0.01 0.00 -0.55 0.00 0.00 41.25 38.22 2g0b s ASN 54 CO 0.05 -0.96 0.70 0.61 -2.79 0.00 0.00 177.10 174.72 2g0b n GLY 55 N 5.01 -0.30 2.30 1.21 0.00 -0.15 -2.53 105.19 110.72 2g0b n GLY 55 Ca 0.11 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2g0b n GLY 55 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2g0b n GLU 56 N -4.32 0.00 -3.46 1.61 1.02 -1.26 -5.03 120.64 109.20 2g0b n GLU 56 Ca -0.27 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.49 2g0b n GLU 56 Cb 0.67 -1.04 -0.06 0.00 -0.02 0.00 0.00 31.44 30.98 2g0b n GLU 56 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2g0b s VAL 57 N -2.56 5.19 -0.04 2.62 -7.23 -1.05 -5.02 120.40 112.30 2g0b s VAL 57 Ca 0.00 0.77 -0.30 0.00 -1.81 0.00 0.00 61.98 60.64 2g0b s VAL 57 Cb 0.00 -3.71 -0.03 0.00 0.56 0.00 0.00 36.38 33.20 2g0b s VAL 57 CO 0.00 0.43 1.05 -0.22 -0.31 0.00 0.00 175.10 176.06 2g0b s LEU 58 N 0.02 4.31 0.00 1.32 2.96 -1.26 -0.10 118.68 125.93 2g0b s LEU 58 Ca 0.22 1.68 0.00 0.00 -0.22 0.00 0.00 54.13 55.81 2g0b s LEU 58 Cb -0.15 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 42.98 2g0b s LEU 58 CO 0.09 -0.41 0.00 0.00 -1.32 0.00 0.00 176.35 174.70 2g0b n TYR 59 N 4.57 0.00 -3.76 5.38 0.18 0.28 -4.92 117.16 118.89 2g0b n TYR 59 Ca 0.08 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.73 2g0b n TYR 59 Cb 0.49 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 39.36 2g0b n TYR 59 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 2g0b s GLY 60 N -1.26 -0.14 0.02 -7.48 0.00 -1.04 0.33 107.32 97.74 2g0b s GLY 60 Ca 0.00 0.26 -0.13 0.00 0.00 0.00 0.00 44.72 44.84 2g0b s GLY 60 CO 0.00 0.05 0.29 -1.08 0.00 0.00 0.00 173.10 172.35 2g0b s THR 61 N -1.55 0.07 -0.13 0.90 -1.32 0.34 0.29 115.64 114.24 2g0b s THR 61 Ca -0.12 -0.61 -0.13 0.00 -1.21 0.00 0.00 61.69 59.62 2g0b s THR 61 Cb -0.04 -0.76 0.04 0.00 -1.51 0.00 0.00 72.50 70.22 2g0b s THR 61 CO 0.03 -0.34 0.38 -0.51 -2.21 0.00 0.00 174.62 171.97 2g0b s ILE 62 N -1.94 0.00 0.32 5.08 2.07 -0.94 -1.33 121.20 124.46 2g0b s ILE 62 Ca -0.09 -0.03 0.08 0.00 -1.41 0.00 0.00 60.65 59.20 2g0b s ILE 62 Cb -0.03 -0.54 -0.06 0.00 0.13 0.00 0.00 42.46 41.96 2g0b s ILE 62 CO 0.00 -0.02 -0.07 -0.44 -1.91 0.00 0.00 174.94 172.51 2g0b s SER 63 N 0.10 3.28 -0.03 4.50 0.01 0.14 0.40 113.70 122.10 2g0b s SER 63 Ca -0.01 -1.21 0.00 0.00 1.31 0.00 0.00 55.95 56.04 2g0b s SER 63 Cb -0.03 -0.27 0.03 0.00 0.21 0.00 0.00 66.02 65.96 2g0b s SER 63 CO 0.01 -0.29 0.00 -0.51 0.41 0.00 0.00 173.24 172.86 2g0b s ILE 64 N -2.81 0.17 -0.19 1.44 2.07 -0.33 -0.61 121.20 120.94 2g0b s ILE 64 Ca 0.31 0.09 -0.03 0.00 -1.41 0.00 0.00 60.65 59.61 2g0b s ILE 64 Cb 0.04 -0.27 -0.01 0.00 0.13 0.00 0.00 42.46 42.34 2g0b s ILE 64 CO 0.15 0.15 -0.05 -0.63 -1.91 0.00 0.00 174.94 172.64 2g0b s ILE 65 N 1.06 3.49 0.18 2.00 1.01 0.03 -1.41 121.20 127.55 2g0b s ILE 65 Ca -0.09 -0.47 -0.26 0.00 0.00 0.00 0.00 60.65 59.83 2g0b s ILE 65 Cb -0.13 -2.56 -0.08 0.00 0.01 0.00 0.00 42.46 39.69 2g0b s ILE 65 CO -0.02 0.45 0.80 0.20 0.00 0.00 0.00 174.94 176.37 2g0b s ASN 66 N 1.06 7.43 -0.39 3.58 0.02 0.16 -1.40 114.94 125.41 2g0b s ASN 66 Ca 0.01 1.69 -0.27 0.00 -1.02 0.00 0.00 52.86 53.27 2g0b s ASN 66 Cb -0.15 -2.52 -0.05 0.00 0.02 0.00 0.00 41.25 38.55 2g0b s ASN 66 CO -0.00 0.20 2.25 -0.62 0.02 0.00 0.00 177.10 178.95 2g0b s ASP 67 N -1.16 4.98 0.00 -1.22 2.15 -0.75 -4.84 116.67 115.83 2g0b s ASP 67 Ca 0.37 1.35 0.00 0.00 0.43 0.00 0.00 52.55 54.69 2g0b s ASP 67 Cb -0.23 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 39.88 2g0b s ASP 67 CO 0.27 -2.41 0.00 0.61 -0.17 0.00 0.00 175.17 173.47 2g0b n GLY 68 N 5.85 6.24 0.05 2.66 0.00 -1.26 -4.91 105.19 113.82 2g0b n GLY 68 Ca 0.32 -1.83 0.11 0.00 0.00 0.00 0.00 46.02 44.62 2g0b n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g0b n ALA 69 N -3.00 1.94 1.11 4.61 0.00 -1.26 -2.34 120.51 121.56 2g0b n ALA 69 Ca 0.00 -0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.54 2g0b n ALA 69 Cb 0.00 -1.37 0.27 0.00 0.00 0.00 0.00 19.45 18.34 2g0b n ALA 69 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2g0b n GLN 70 N -1.84 2.10 0.00 0.00 1.13 -1.26 -5.07 117.38 112.43 2g0b n GLN 70 Ca 0.04 -1.60 0.00 0.00 -1.94 0.00 0.00 57.00 53.50 2g0b n GLN 70 Cb 0.27 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.16 2g0b n GLN 70 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2g0b n GLY 71 N 1.30 0.03 3.24 1.08 0.00 -0.99 -4.86 105.19 104.98 2g0b n GLY 71 Ca 0.16 -0.95 -0.20 0.00 0.00 0.00 0.00 46.02 45.02 2g0b n GLY 71 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g0b s LEU 72 N 0.00 2.32 0.54 0.99 1.43 -1.26 -4.17 118.68 118.52 2g0b s LEU 72 Ca 0.00 -0.69 0.26 0.00 -1.03 0.00 0.00 54.13 52.66 2g0b s LEU 72 Cb 0.00 -0.67 1.43 0.00 0.03 0.00 0.00 46.19 46.97 2g0b s LEU 72 CO 0.00 -0.04 2.00 -0.65 0.23 0.00 0.00 176.35 177.89 2g0b h PRO 73 N 4.00 0.00 -0.63 1.29 0.11 -1.97 -0.99 132.00 133.81 2g0b h PRO 73 Ca -0.43 0.00 0.18 0.00 0.11 0.00 0.00 66.00 65.86 2g0b h PRO 73 Cb 1.19 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 2g0b h PRO 73 CO 0.43 0.00 0.45 0.52 -0.21 0.00 0.00 178.00 179.19 2g0b h MET 74 N 0.00 0.04 -0.62 1.05 2.86 -1.97 -3.17 114.93 113.12 2g0b h MET 74 Ca 0.23 -0.00 0.17 0.00 -2.06 0.00 0.00 59.70 58.04 2g0b h MET 74 Cb 0.96 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.58 2g0b h MET 74 CO -0.00 0.03 0.44 -0.44 1.06 0.00 0.00 176.91 177.99 2g0b h ASP 75 N 0.04 0.05 0.65 1.22 5.19 -1.48 0.57 116.42 122.66 2g0b h ASP 75 Ca 0.30 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.71 2g0b h ASP 75 Cb 1.15 -0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.65 2g0b h ASP 75 CO -0.02 0.03 -0.01 0.77 -3.12 0.00 0.00 179.24 176.89 2g0b h SER 76 N 0.05 0.00 0.00 6.45 4.64 -1.78 -3.15 113.55 119.77 2g0b h SER 76 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 2g0b h SER 76 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2g0b h SER 76 CO -0.02 0.01 -0.78 -0.38 -0.87 0.00 0.00 176.83 174.79 2g0b n ILE 77 N -3.13 0.00 -1.69 0.95 2.08 -0.15 -4.89 119.36 112.54 2g0b n ILE 77 Ca -0.01 0.00 -0.00 0.00 0.56 0.00 0.00 62.75 63.30 2g0b n ILE 77 Cb 0.23 -0.46 0.17 0.00 -0.75 0.00 0.00 39.64 38.83 2g0b n ILE 77 CO 0.00 0.00 0.00 -1.22 0.56 0.00 0.00 176.55 175.89 2g0b n TYR 78 N -2.33 0.58 0.05 1.39 4.02 0.18 -4.82 117.16 116.23 2g0b n TYR 78 Ca 0.00 -1.65 -0.11 0.00 -0.01 0.00 0.00 57.90 56.13 2g0b n TYR 78 Cb 0.39 -0.27 -0.04 0.00 -0.02 0.00 0.00 39.34 39.40 2g0b n TYR 78 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2g0b h ALA 79 N 1.25 -0.20 0.00 -0.72 0.00 -1.66 -2.84 119.26 115.09 2g0b h ALA 79 Ca 0.08 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2g0b h ALA 79 Cb 1.12 0.30 0.00 0.00 0.00 0.00 0.00 17.79 19.20 2g0b h ALA 79 CO 0.16 -0.66 0.00 -0.39 0.00 0.00 0.00 179.25 178.36 2g0b h VAL 80 N -0.27 0.00 0.00 0.00 -1.51 -1.89 -0.67 116.25 111.91 2g0b h VAL 80 Ca 0.06 -0.35 0.00 0.00 -1.23 0.00 0.00 66.70 65.18 2g0b h VAL 80 Cb 0.34 1.18 0.00 0.00 -2.13 0.00 0.00 31.29 30.68 2g0b h VAL 80 CO -0.16 0.00 0.00 -0.33 -1.23 0.00 0.00 177.57 175.85 2g0b h GLU 81 N 0.00 0.00 0.00 5.19 3.07 -1.86 -3.26 114.58 117.72 2g0b h GLU 81 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2g0b h GLU 81 Cb 0.47 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 2g0b h GLU 81 CO 0.00 0.00 -1.49 1.28 -1.40 0.00 0.00 179.01 177.40 2g0b n LEU 82 N -2.90 0.24 -0.34 1.33 4.77 -0.34 -4.64 117.00 115.13 2g0b n LEU 82 Ca 0.04 -0.15 0.05 0.00 -0.03 0.00 0.00 56.01 55.91 2g0b n LEU 82 Cb 0.46 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.76 2g0b n LEU 82 CO 0.32 0.06 1.21 0.00 -1.33 0.00 0.00 177.39 177.65 2g0b h ALA 83 N 1.84 1.39 -0.32 -1.18 0.00 -1.38 -1.94 119.26 117.67 2g0b h ALA 83 Ca 0.00 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.96 2g0b h ALA 83 Cb 0.68 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2g0b h ALA 83 CO 0.00 0.22 0.13 0.00 0.00 0.00 0.00 179.25 179.61 2g0b h ALA 84 N 1.50 0.38 -0.57 0.00 0.00 -1.82 -0.85 119.26 117.89 2g0b h ALA 84 Ca 0.46 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.31 2g0b h ALA 84 Cb 0.40 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2g0b h ALA 84 CO -0.24 -0.26 0.03 -1.49 0.00 0.00 0.00 179.25 177.29 2g0b h TRP 85 N 0.29 1.02 0.00 0.00 6.55 -1.69 -2.36 115.95 119.76 2g0b h TRP 85 Ca 0.14 -0.15 -0.07 0.00 0.95 0.00 0.00 58.89 59.76 2g0b h TRP 85 Cb 0.08 -0.28 -0.01 0.00 -0.86 0.00 0.00 29.16 28.10 2g0b h TRP 85 CO -0.12 0.90 -0.33 0.00 -1.05 0.00 0.00 178.44 177.84 2g0b h ARG 86 N 0.89 0.00 -0.29 0.49 3.08 -1.03 -2.04 114.38 115.48 2g0b h ARG 86 Ca 0.17 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.07 2g0b h ARG 86 Cb 0.47 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2g0b h ARG 86 CO 0.02 0.33 -0.42 0.78 -1.07 0.00 0.00 179.97 179.62 2g0b h GLY 87 N 1.30 0.78 1.39 0.04 0.00 -0.66 -3.02 103.07 102.90 2g0b h GLY 87 Ca -0.00 -0.80 0.00 0.00 0.00 0.00 0.00 47.33 46.53 2g0b h GLY 87 CO 0.04 0.72 0.00 1.18 0.00 0.00 0.00 176.54 178.48 2g0b n GLU 88 N -4.03 0.57 -2.44 4.80 1.02 -0.92 -4.91 120.64 114.73 2g0b n GLU 88 Ca -0.02 0.01 -0.04 0.00 -0.02 0.00 0.00 57.16 57.09 2g0b n GLU 88 Cb 0.54 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.48 2g0b n GLU 88 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2g0b n GLY 89 N 1.06 0.42 3.79 0.62 0.00 -1.01 -5.03 105.19 105.04 2g0b n GLY 89 Ca 0.16 -0.41 -0.37 0.00 0.00 0.00 0.00 46.02 45.41 2g0b n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g0b s LYS 90 N -4.62 3.94 -0.32 1.61 -0.14 -0.81 -5.04 119.74 114.35 2g0b s LYS 90 Ca 0.04 0.03 -0.29 0.00 -1.36 0.00 0.00 55.97 54.39 2g0b s LYS 90 Cb -0.02 -3.32 -0.00 0.00 -1.68 0.00 0.00 37.83 32.82 2g0b s LYS 90 CO 0.15 0.50 1.37 0.21 -0.76 0.00 0.00 175.35 176.81 2g0b s LYS 91 N -0.29 3.81 0.18 1.68 2.20 -1.26 -4.71 119.74 121.35 2g0b s LYS 91 Ca 0.16 1.23 0.07 0.00 -0.36 0.00 0.00 55.97 57.07 2g0b s LYS 91 Cb -0.13 -3.94 -0.04 0.00 -1.51 0.00 0.00 37.83 32.21 2g0b s LYS 91 CO 0.05 -1.25 0.03 -0.51 -0.36 0.00 0.00 175.35 173.30 2g0b s LEU 92 N 4.75 3.42 -0.17 5.43 1.43 -1.26 -1.35 118.68 130.93 2g0b s LEU 92 Ca 0.60 -0.35 -0.16 0.00 -1.03 0.00 0.00 54.13 53.18 2g0b s LEU 92 Cb -0.17 -2.05 0.04 0.00 0.03 0.00 0.00 46.19 44.04 2g0b s LEU 92 CO 0.26 0.08 0.46 0.00 0.23 0.00 0.00 176.35 177.38 2g0b s ALA 93 N -1.78 -1.13 -0.18 4.21 0.00 -0.94 -1.81 121.76 120.12 2g0b s ALA 93 Ca 0.29 1.27 -0.05 0.00 0.00 0.00 0.00 51.96 53.47 2g0b s ALA 93 Cb -0.09 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 22.28 2g0b s ALA 93 CO 0.20 -0.22 -0.00 -2.00 0.00 0.00 0.00 175.76 173.73 2g0b s GLU 94 N 0.18 3.70 -0.13 0.00 2.12 -0.50 -0.44 118.70 123.64 2g0b s GLU 94 Ca -0.00 -0.49 -0.24 0.00 0.36 0.00 0.00 54.97 54.59 2g0b s GLU 94 Cb -0.03 -3.04 -0.02 0.00 0.26 0.00 0.00 34.13 31.29 2g0b s GLU 94 CO 0.01 0.14 0.77 0.08 -0.54 0.00 0.00 175.26 175.72 2g0b s VAL 95 N 0.65 4.96 0.07 3.70 1.01 -0.47 -0.79 120.40 129.53 2g0b s VAL 95 Ca -0.00 1.53 -0.05 0.00 0.00 0.00 0.00 61.98 63.46 2g0b s VAL 95 Cb -0.14 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.13 2g0b s VAL 95 CO 0.02 0.12 0.08 0.54 0.00 0.00 0.00 175.10 175.86 2g0b s VAL 96 N 1.59 0.18 -1.45 2.92 0.11 0.22 -4.63 120.40 119.34 2g0b s VAL 96 Ca 0.37 -1.50 -0.10 0.00 -2.93 0.00 0.00 61.98 57.82 2g0b s VAL 96 Cb -0.17 -1.45 0.05 0.00 -1.53 0.00 0.00 36.38 33.29 2g0b s VAL 96 CO 0.15 -0.81 0.99 0.00 -3.33 0.00 0.00 175.10 172.10 2g0b n GLN 97 N 0.02 -6.06 -2.64 1.54 1.13 -1.26 -0.69 117.38 109.42 2g0b n GLN 97 Ca -0.14 0.66 -0.43 0.00 -1.94 0.00 0.00 57.00 55.15 2g0b n GLN 97 Cb 0.62 -5.55 -0.02 0.00 0.11 0.00 0.00 30.24 25.39 2g0b n GLN 97 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 2g0b s PHE 98 N -3.36 3.38 -0.15 1.08 5.36 -1.26 -4.10 117.98 118.93 2g0b s PHE 98 Ca 0.53 1.47 -0.19 0.00 -0.96 0.00 0.00 56.93 57.78 2g0b s PHE 98 Cb -0.26 -3.26 0.05 0.00 -0.34 0.00 0.00 43.02 39.21 2g0b s PHE 98 CO 0.80 -0.52 0.50 0.00 -1.46 0.00 0.00 175.22 174.54 2g0b s ALA 99 N 2.55 -1.26 0.00 11.12 0.00 -0.44 -5.01 121.76 128.71 2g0b s ALA 99 Ca 0.48 1.26 0.04 0.00 0.00 0.00 0.00 51.96 53.75 2g0b s ALA 99 Cb -0.18 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.32 2g0b s ALA 99 CO 0.14 -0.26 -0.14 -1.64 0.00 0.00 0.00 175.76 173.86 2g0b s MET 100 N -0.15 1.08 -0.43 0.00 -1.94 -1.26 -0.51 119.30 116.10 2g0b s MET 100 Ca -0.03 -0.58 -0.18 0.00 -1.71 0.00 0.00 55.69 53.19 2g0b s MET 100 Cb -0.03 -1.06 0.03 0.00 2.01 0.00 0.00 34.83 35.77 2g0b s MET 100 CO 0.02 0.28 0.47 0.34 -0.01 0.00 0.00 175.02 176.13 2g0b s ASP 101 N -0.56 6.21 0.60 3.03 2.15 0.15 -4.89 116.67 123.36 2g0b s ASP 101 Ca 0.04 -0.69 0.38 0.00 0.43 0.00 0.00 52.55 52.71 2g0b s ASP 101 Cb -0.06 -2.24 1.79 0.00 -0.30 0.00 0.00 42.92 42.11 2g0b s ASP 101 CO -0.00 -0.63 2.14 1.12 -0.17 0.00 0.00 175.17 177.63 2g0b h HIS 102 N 8.77 0.00 0.00 -5.34 2.07 -1.88 -2.51 115.15 116.26 2g0b h HIS 102 Ca -0.26 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.11 2g0b h HIS 102 Cb 1.11 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.07 2g0b h HIS 102 CO 0.64 0.00 -0.69 1.79 -3.07 0.00 0.00 177.93 176.61 2g0b h THR 103 N 0.00 1.28 -0.01 6.12 1.35 -1.97 -3.30 112.91 116.38 2g0b h THR 103 Ca -0.00 -2.55 0.00 0.00 -0.55 0.00 0.00 66.41 63.31 2g0b h THR 103 Cb 0.31 2.46 0.00 0.00 -1.73 0.00 0.00 68.15 69.19 2g0b h THR 103 CO 0.00 0.67 -0.28 0.18 -0.25 0.00 0.00 175.52 175.84 2g0b n LEU 104 N -3.41 1.47 -3.89 3.87 4.77 -0.95 -4.82 117.00 114.05 2g0b n LEU 104 Ca 0.00 -0.47 -0.20 0.00 -0.03 0.00 0.00 56.01 55.32 2g0b n LEU 104 Cb 0.76 -0.07 -0.16 0.00 -2.33 0.00 0.00 43.42 41.62 2g0b n LEU 104 CO 0.43 0.27 -0.41 -0.72 -1.33 0.00 0.00 177.39 175.63 2g0b s TYR 105 N -2.42 0.72 -0.70 -1.77 1.13 -1.22 -4.91 117.35 108.18 2g0b s TYR 105 Ca 0.24 -0.19 -0.26 0.00 -1.41 0.00 0.00 57.07 55.45 2g0b s TYR 105 Cb 0.19 -0.64 -0.11 0.00 -1.10 0.00 0.00 41.96 40.30 2g0b s TYR 105 CO 0.51 -0.18 2.38 -1.21 -2.51 0.00 0.00 175.55 174.53 2g0b s GLU 106 N 0.88 1.81 0.89 -3.49 8.01 -1.26 -4.84 118.70 120.70 2g0b s GLU 106 Ca -0.12 0.74 -0.14 0.00 0.01 0.00 0.00 54.97 55.47 2g0b s GLU 106 Cb -0.14 -4.73 0.14 0.00 -4.31 0.00 0.00 34.13 25.09 2g0b s GLU 106 CO 0.00 -4.01 1.21 0.00 0.01 0.00 0.00 175.26 172.48 2g0b s ALA 107 N 13.67 2.27 0.22 5.21 0.00 -1.26 -4.97 121.76 136.90 2g0b s ALA 107 Ca 0.92 -0.81 0.05 0.00 0.00 0.00 0.00 51.96 52.12 2g0b s ALA 107 Cb -0.14 -2.91 0.18 0.00 0.00 0.00 0.00 23.12 20.25 2g0b s ALA 107 CO 0.13 -2.11 1.51 0.28 0.00 0.00 0.00 175.76 175.58 2g0b h VAL 108 N -1.39 1.43 -5.39 0.00 2.07 -2.00 -3.53 116.25 107.45 2g0b h VAL 108 Ca -0.46 -2.21 -0.01 0.00 0.82 0.00 0.00 66.70 64.84 2g0b h VAL 108 Cb 1.30 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 33.24 2g0b h VAL 108 CO 0.55 0.65 -0.03 0.00 0.02 0.00 0.00 177.57 178.76 2g0b n ALA 109 N -2.46 -2.51 0.00 1.67 0.00 -1.26 -5.28 120.51 110.67 2g0b n ALA 109 Ca -0.03 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2g0b n ALA 109 Cb 0.68 -1.53 0.00 0.00 0.00 0.00 0.00 19.45 18.60 2g0b n ALA 109 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2g0b n SER 114 N -1.76 0.00 0.29 0.00 7.64 -1.26 -5.23 113.62 113.30 2g0b n SER 114 Ca -0.00 0.00 0.15 0.00 1.01 0.00 0.00 58.87 60.03 2g0b n SER 114 Cb 0.50 0.00 0.87 0.00 -1.01 0.00 0.00 64.21 64.57 2g0b n SER 114 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2g0b h PRO 115 N 0.00 0.00 0.00 1.43 0.11 -2.04 -2.99 132.00 128.52 2g0b h PRO 115 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2g0b h PRO 115 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2g0b h PRO 115 CO 0.00 0.05 0.00 1.97 -0.21 0.00 0.00 178.00 179.81 2g0b n PHE 116 N -3.60 0.00 0.71 0.65 1.16 -1.26 -1.78 117.46 113.35 2g0b n PHE 116 Ca -0.02 0.00 0.12 0.00 -1.87 0.00 0.00 57.45 55.68 2g0b n PHE 116 Cb 0.16 0.00 0.23 0.00 -1.61 0.00 0.00 39.48 38.26 2g0b n PHE 116 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 2g0b n GLU 117 N -0.73 2.29 -0.63 3.97 1.02 -1.13 -3.75 120.64 121.68 2g0b n GLU 117 Ca 0.10 -1.92 0.03 0.00 -0.02 0.00 0.00 57.16 55.35 2g0b n GLU 117 Cb 0.04 -1.48 0.26 0.00 -0.02 0.00 0.00 31.44 30.25 2g0b n GLU 117 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2g0b n ALA 118 N 1.19 3.56 -0.36 0.62 0.00 -0.73 -4.75 120.51 120.04 2g0b n ALA 118 Ca 0.17 -2.47 0.09 0.00 0.00 0.00 0.00 53.44 51.23 2g0b n ALA 118 Cb 0.54 -0.82 0.26 0.00 0.00 0.00 0.00 19.45 19.43 2g0b n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g0b h ALA 119 N 1.86 1.56 -0.01 0.00 0.00 -1.73 -0.99 119.26 119.94 2g0b h ALA 119 Ca 0.09 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 2g0b h ALA 119 Cb 1.66 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 2g0b h ALA 119 CO 0.36 0.12 -0.65 0.66 0.00 0.00 0.00 179.25 179.74 2g0b h SER 120 N 0.91 0.05 -0.52 0.00 4.64 -1.92 -1.02 113.55 115.69 2g0b h SER 120 Ca 0.52 -0.03 -0.09 0.00 -0.47 0.00 0.00 61.79 61.72 2g0b h SER 120 Cb 0.63 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.68 2g0b h SER 120 CO -0.31 0.69 -0.02 -0.07 -0.87 0.00 0.00 176.83 176.25 2g0b h LEU 121 N 0.03 0.96 -0.44 5.97 3.38 -1.63 -2.84 115.31 120.73 2g0b h LEU 121 Ca -0.01 -0.27 -0.12 0.00 0.09 0.00 0.00 57.88 57.57 2g0b h LEU 121 Cb 1.16 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 2g0b h LEU 121 CO 0.09 1.02 -0.19 -0.26 0.09 0.00 0.00 178.44 179.19 2g0b h PHE 122 N 0.89 1.05 -0.99 1.13 0.05 -0.83 -2.37 116.94 115.87 2g0b h PHE 122 Ca 0.16 -0.25 0.05 0.00 3.82 0.00 0.00 57.97 61.74 2g0b h PHE 122 Cb 0.55 -0.24 -0.06 0.00 2.00 0.00 0.00 35.95 38.20 2g0b h PHE 122 CO 0.04 1.04 0.65 1.15 -0.18 0.00 0.00 178.31 181.01 2g0b h THR 123 N 0.75 1.14 -0.70 -1.55 2.02 -1.18 0.11 112.91 113.50 2g0b h THR 123 Ca 0.10 -0.42 -0.06 0.00 0.77 0.00 0.00 66.41 66.80 2g0b h THR 123 Cb 0.75 -0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 2g0b h THR 123 CO 0.06 0.22 0.20 0.24 0.37 0.00 0.00 175.52 176.62 2g0b h MET 124 N 1.22 1.08 -0.22 6.66 2.86 -1.30 0.99 114.93 126.22 2g0b h MET 124 Ca 0.41 -0.23 -0.04 0.00 -2.06 0.00 0.00 59.70 57.77 2g0b h MET 124 Cb 0.06 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 2g0b h MET 124 CO -0.14 0.93 -0.03 0.28 1.06 0.00 0.00 176.91 179.01 2g0b h VAL 125 N 1.04 1.27 -0.22 -2.22 2.07 -0.80 -2.24 116.25 115.16 2g0b h VAL 125 Ca 0.22 -0.98 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 2g0b h VAL 125 Cb 0.31 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 2g0b h VAL 125 CO -0.01 0.30 0.13 0.25 0.02 0.00 0.00 177.57 178.27 2g0b h LEU 126 N 0.15 0.26 -0.62 2.57 5.85 -0.65 -0.89 115.31 121.98 2g0b h LEU 126 Ca 0.06 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.75 2g0b h LEU 126 Cb 0.46 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 2g0b h LEU 126 CO 0.02 0.22 0.40 0.71 -0.34 0.00 0.00 178.44 179.44 2g0b h THR 127 N 0.27 1.12 -0.67 1.05 1.35 -0.82 -0.94 112.91 114.28 2g0b h THR 127 Ca 0.08 -0.27 0.07 0.00 -0.55 0.00 0.00 66.41 65.73 2g0b h THR 127 Cb 0.01 0.25 -0.06 0.00 -1.73 0.00 0.00 68.15 66.62 2g0b h THR 127 CO -0.02 0.15 0.36 0.22 -0.25 0.00 0.00 175.52 175.98 2g0b h TYR 128 N 0.80 0.66 0.00 4.73 3.20 -1.20 -0.60 116.97 124.56 2g0b h TYR 128 Ca 0.24 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.07 2g0b h TYR 128 Cb -0.05 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.02 2g0b h TYR 128 CO -0.04 0.30 -0.30 0.00 -1.64 0.00 0.00 178.16 176.48 2g0b h ALA 129 N 1.36 1.25 0.00 1.82 0.00 -0.44 0.11 119.26 123.36 2g0b h ALA 129 Ca 0.31 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2g0b h ALA 129 Cb 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2g0b h ALA 129 CO -0.20 0.38 -0.53 -0.07 0.00 0.00 0.00 179.25 178.83 2g0b h LEU 130 N 0.00 0.00 0.09 0.00 3.38 -0.47 -1.62 115.31 116.70 2g0b h LEU 130 Ca -0.00 -0.02 -0.37 0.00 0.09 0.00 0.00 57.88 57.58 2g0b h LEU 130 Cb 0.63 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 2g0b h LEU 130 CO 0.04 0.01 -2.09 -0.62 0.09 0.00 0.00 178.44 175.87 2g0b n GLU 131 N -2.79 0.73 0.00 1.13 1.02 -0.30 -4.04 120.64 116.39 2g0b n GLU 131 Ca 0.02 0.25 0.08 0.00 -0.02 0.00 0.00 57.16 57.48 2g0b n GLU 131 Cb 0.53 -1.67 0.36 0.00 -0.02 0.00 0.00 31.44 30.64 2g0b n GLU 131 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2g0b n THR 132 N -3.47 0.81 -3.57 2.62 -1.04 0.33 -4.89 114.28 105.08 2g0b n THR 132 Ca -0.35 0.20 -0.23 0.00 -2.04 0.00 0.00 64.05 61.63 2g0b n THR 132 Cb 1.02 -0.93 0.08 0.00 -1.82 0.00 0.00 70.33 68.68 2g0b n THR 132 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2g0b n HIS 133 N -1.44 -2.82 -2.24 -1.42 8.25 -1.18 -4.97 115.22 109.39 2g0b n HIS 133 Ca 0.05 0.99 -0.41 0.00 -0.26 0.00 0.00 57.72 58.09 2g0b n HIS 133 Cb 0.17 -4.94 -0.03 0.00 1.12 0.00 0.00 29.99 26.31 2g0b n HIS 133 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2g0b s ILE 134 N -3.31 3.07 -0.12 1.59 1.01 -0.61 -4.86 121.20 117.97 2g0b s ILE 134 Ca 0.57 1.02 -0.05 0.00 0.00 0.00 0.00 60.65 62.18 2g0b s ILE 134 Cb -0.25 -3.65 -0.02 0.00 0.01 0.00 0.00 42.46 38.55 2g0b s ILE 134 CO 0.71 0.22 -0.07 0.44 0.00 0.00 0.00 174.94 176.23 2g0b h ASP 135 N 4.08 0.00 -3.25 3.58 3.32 -1.53 -3.40 116.42 119.22 2g0b h ASP 135 Ca -0.47 -0.02 -0.67 0.00 0.02 0.00 0.00 57.03 55.89 2g0b h ASP 135 Cb 1.22 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 40.46 2g0b h ASP 135 CO 0.69 0.65 -0.81 -0.31 -1.72 0.00 0.00 179.24 177.74 2g0b s TYR 136 N -1.92 2.78 -0.40 4.55 1.51 -0.87 -1.09 117.35 121.90 2g0b s TYR 136 Ca -0.08 -1.14 -0.17 0.00 -1.01 0.00 0.00 57.07 54.67 2g0b s TYR 136 Cb 0.01 -1.90 0.01 0.00 -0.11 0.00 0.00 41.96 39.98 2g0b s TYR 136 CO 0.13 -0.53 0.44 -1.17 -1.11 0.00 0.00 175.55 173.30 2g0b s LEU 137 N 0.91 4.73 0.01 -1.29 2.96 -0.46 -2.22 118.68 123.31 2g0b s LEU 137 Ca -0.04 -0.53 -0.02 0.00 -0.22 0.00 0.00 54.13 53.33 2g0b s LEU 137 Cb -0.15 -2.41 -0.04 0.00 0.50 0.00 0.00 46.19 44.09 2g0b s LEU 137 CO -0.02 -0.54 0.17 0.00 -1.32 0.00 0.00 176.35 174.64 2g0b s ILE 139 N -1.34 -0.00 -0.23 0.00 -4.36 0.10 -1.36 121.20 114.00 2g0b s ILE 139 Ca 0.28 0.02 -0.01 0.00 -0.26 0.00 0.00 60.65 60.68 2g0b s ILE 139 Cb -0.13 -0.03 0.02 0.00 1.25 0.00 0.00 42.46 43.58 2g0b s ILE 139 CO 0.20 0.01 -0.10 -0.94 0.24 0.00 0.00 174.94 174.35 2g0b s SER 140 N 0.10 4.05 0.12 4.36 1.04 -1.26 -0.74 113.70 121.37 2g0b s SER 140 Ca -0.01 -0.81 0.08 0.00 0.48 0.00 0.00 55.95 55.69 2g0b s SER 140 Cb -0.01 -1.62 -0.04 0.00 0.10 0.00 0.00 66.02 64.45 2g0b s SER 140 CO -0.00 -0.09 -0.19 0.27 0.98 0.00 0.00 173.24 174.21 2g0b s ILE 141 N 1.31 1.65 0.25 -1.02 -4.36 -0.83 -4.94 121.20 113.28 2g0b s ILE 141 Ca 0.01 -1.67 -0.30 0.00 -0.26 0.00 0.00 60.65 58.43 2g0b s ILE 141 Cb -0.16 -1.61 -0.10 0.00 1.25 0.00 0.00 42.46 41.84 2g0b s ILE 141 CO -0.06 -0.20 1.50 0.21 0.24 0.00 0.00 174.94 176.63 2g0b s ASN 142 N -2.20 6.56 0.33 4.36 3.84 -1.26 -2.21 114.94 124.35 2g0b s ASN 142 Ca 0.09 2.75 0.11 0.00 0.21 0.00 0.00 52.86 56.02 2g0b s ASN 142 Cb -0.08 -2.62 0.62 0.00 -0.55 0.00 0.00 41.25 38.62 2g0b s ASN 142 CO 0.05 -0.78 1.23 -2.65 -2.79 0.00 0.00 177.10 172.15 2g0b n PRO 143 N 2.49 0.08 0.19 0.43 -0.02 -1.26 -1.63 135.00 135.28 2g0b n PRO 143 Ca 0.08 0.56 0.07 0.00 -2.02 0.00 0.00 63.50 62.18 2g0b n PRO 143 Cb 0.39 -2.12 0.26 0.00 -0.02 0.00 0.00 33.50 32.02 2g0b n PRO 143 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2g0b h LYS 144 N 0.00 0.00 -0.65 -0.52 2.10 -1.97 -2.96 116.57 112.57 2g0b h LYS 144 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2g0b h LYS 144 Cb 0.72 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.05 2g0b h LYS 144 CO 0.00 0.33 0.00 0.72 -2.00 0.00 0.00 179.45 178.50 2g0b n HIS 145 N -3.33 1.00 -0.10 0.07 8.25 -0.64 -4.60 115.22 115.86 2g0b n HIS 145 Ca 0.01 -0.53 -0.07 0.00 -0.26 0.00 0.00 57.72 56.88 2g0b n HIS 145 Cb 0.56 -0.06 0.01 0.00 1.12 0.00 0.00 29.99 31.62 2g0b n HIS 145 CO 0.00 0.00 0.00 0.22 0.64 0.00 0.00 176.34 177.20 2g0b h ASP 146 N 3.87 0.17 0.59 0.41 -0.00 -1.62 -2.21 116.42 117.63 2g0b h ASP 146 Ca 0.00 0.03 -0.08 0.00 -0.00 0.00 0.00 57.03 56.98 2g0b h ASP 146 Cb 1.05 0.01 -0.01 0.00 -0.00 0.00 0.00 39.33 40.38 2g0b h ASP 146 CO 0.05 0.14 -0.39 0.00 -0.00 0.00 0.00 179.24 179.03 2g0b h THR 147 N 0.30 1.09 -0.13 2.25 1.03 -1.82 -2.67 112.91 112.96 2g0b h THR 147 Ca 0.16 -1.45 -0.04 0.00 -0.01 0.00 0.00 66.41 65.06 2g0b h THR 147 Cb 0.11 1.83 -0.00 0.00 -1.07 0.00 0.00 68.15 69.02 2g0b h THR 147 CO -0.15 0.39 -0.09 0.15 -0.01 0.00 0.00 175.52 175.81 2g0b h PHE 148 N 0.00 0.35 0.00 0.00 3.57 -1.73 -2.76 116.94 116.37 2g0b h PHE 148 Ca -0.00 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.36 2g0b h PHE 148 Cb 0.79 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.45 2g0b h PHE 148 CO 0.00 0.66 -0.21 1.88 -2.23 0.00 0.00 178.31 178.40 2g0b h TYR 149 N -0.06 0.00 -0.45 0.41 -1.99 -1.44 -2.33 116.97 111.10 2g0b h TYR 149 Ca 0.03 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.66 2g0b h TYR 149 Cb 0.58 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.29 2g0b h TYR 149 CO 0.07 0.21 -0.13 0.66 -0.00 0.00 0.00 178.16 178.98 2g0b h SER 150 N 0.00 0.83 -0.65 3.88 4.64 -1.39 -1.62 113.55 119.23 2g0b h SER 150 Ca -0.00 -0.26 -0.09 0.00 -0.47 0.00 0.00 61.79 60.97 2g0b h SER 150 Cb 0.76 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.60 2g0b h SER 150 CO 0.03 0.97 0.07 0.25 -0.87 0.00 0.00 176.83 177.28 2g0b h LEU 151 N 0.75 1.07 0.00 5.97 5.85 -1.15 -2.09 115.31 125.71 2g0b h LEU 151 Ca 0.12 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.57 2g0b h LEU 151 Cb 0.63 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.37 2g0b h LEU 151 CO 0.04 1.08 0.00 0.18 -0.34 0.00 0.00 178.44 179.40 2g0b n LEU 152 N -4.20 0.00 0.00 2.25 4.77 -0.92 -3.99 117.00 114.91 2g0b n LEU 152 Ca 0.04 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 2g0b n LEU 152 Cb 0.31 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2g0b n LEU 152 CO 0.44 -0.13 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 2g0b n GLY 153 N -0.38 0.62 3.69 -0.72 0.00 -0.78 -4.75 105.19 102.87 2g0b n GLY 153 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2g0b n GLY 153 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2g0b s PHE 154 N -2.00 3.14 0.10 1.61 0.40 -0.64 -4.76 117.98 115.83 2g0b s PHE 154 Ca 0.00 1.16 -0.14 0.00 -0.60 0.00 0.00 56.93 57.35 2g0b s PHE 154 Cb 0.00 -3.45 -0.06 0.00 0.51 0.00 0.00 43.02 40.01 2g0b s PHE 154 CO 0.00 -1.45 0.50 0.99 0.70 0.00 0.00 175.22 175.96 2g0b s THR 155 N 2.27 4.91 -0.03 0.64 2.01 0.27 -4.23 115.64 121.49 2g0b s THR 155 Ca 0.57 0.82 -0.30 0.00 0.31 0.00 0.00 61.69 63.08 2g0b s THR 155 Cb -0.25 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.48 2g0b s THR 155 CO 0.22 0.36 1.23 -1.58 -0.69 0.00 0.00 174.62 174.16 2g0b s GLN 156 N -1.67 4.35 -0.00 4.92 0.74 -1.26 -0.70 119.66 126.04 2g0b s GLN 156 Ca 0.33 1.73 0.02 0.00 0.05 0.00 0.00 55.36 57.50 2g0b s GLN 156 Cb -0.16 -3.53 -0.03 0.00 1.10 0.00 0.00 33.01 30.39 2g0b s GLN 156 CO 0.18 -0.44 0.08 0.44 -0.55 0.00 0.00 175.29 174.99 2g0b n ILE 157 N 4.53 0.00 -4.15 -2.34 -5.35 0.42 -4.92 119.36 107.55 2g0b n ILE 157 Ca 0.11 -0.27 -0.16 0.00 -0.27 0.00 0.00 62.75 62.17 2g0b n ILE 157 Cb 0.46 0.75 -0.12 0.00 -1.74 0.00 0.00 39.64 38.99 2g0b n ILE 157 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2g0b s GLY 158 N -1.69 0.57 0.99 3.28 0.00 -0.76 -4.92 107.32 104.79 2g0b s GLY 158 Ca 0.00 -0.73 -0.13 0.00 0.00 0.00 0.00 44.72 43.87 2g0b s GLY 158 CO 0.10 -0.75 1.11 0.00 0.00 0.00 0.00 173.10 173.56 2g0b s ALA 159 N -1.07 1.15 -0.41 3.20 0.00 -1.26 -3.03 121.76 120.35 2g0b s ALA 159 Ca -0.05 -0.47 -0.29 0.00 0.00 0.00 0.00 51.96 51.16 2g0b s ALA 159 Cb -0.08 -3.07 0.00 0.00 0.00 0.00 0.00 23.12 19.97 2g0b s ALA 159 CO 0.01 -2.74 1.49 -1.17 0.00 0.00 0.00 175.76 173.35 2g0b s LEU 160 N -6.37 3.55 0.44 0.00 2.96 -1.26 -4.27 118.68 113.73 2g0b s LEU 160 Ca 0.65 0.88 0.03 0.00 -0.22 0.00 0.00 54.13 55.47 2g0b s LEU 160 Cb -0.17 -3.50 -0.03 0.00 0.50 0.00 0.00 46.19 42.99 2g0b s LEU 160 CO 0.56 -1.52 0.06 -0.54 -1.32 0.00 0.00 176.35 173.60 2g0b s LYS 161 N 5.14 2.01 -0.27 1.98 1.02 -0.17 -4.93 119.74 124.51 2g0b s LYS 161 Ca 0.64 -2.23 -0.15 0.00 0.02 0.00 0.00 55.97 54.25 2g0b s LYS 161 Cb -0.15 -1.09 -0.04 0.00 -0.52 0.00 0.00 37.83 36.03 2g0b s LYS 161 CO 0.32 -0.37 0.39 -1.58 -0.92 0.00 0.00 175.35 173.20 2g0b s HIS 162 N -3.04 3.25 -0.62 3.18 5.65 -1.26 -1.26 115.29 121.18 2g0b s HIS 162 Ca 0.19 0.42 -0.22 0.00 0.25 0.00 0.00 55.06 55.70 2g0b s HIS 162 Cb 0.03 -2.59 0.07 0.00 -1.18 0.00 0.00 32.58 28.91 2g0b s HIS 162 CO 0.10 -0.24 0.92 -0.47 -0.65 0.00 0.00 174.74 174.40 2g0b s TYR 163 N 2.10 2.74 0.25 3.88 5.04 -0.24 -4.92 117.35 126.20 2g0b s TYR 163 Ca 0.16 -0.48 -0.05 0.00 -2.44 0.00 0.00 57.07 54.25 2g0b s TYR 163 Cb -0.16 -4.18 0.29 0.00 0.35 0.00 0.00 41.96 38.26 2g0b s TYR 163 CO 0.10 -1.53 1.92 0.78 -1.34 0.00 0.00 175.55 175.48 2g0b h GLY 164 N 11.08 1.44 -0.06 8.97 0.00 -1.96 0.12 103.07 122.66 2g0b h GLY 164 Ca -0.28 -0.52 0.16 0.00 0.00 0.00 0.00 47.33 46.69 2g0b h GLY 164 CO 1.14 0.49 0.21 -0.84 0.00 0.00 0.00 176.54 177.54 2g0b h THR 165 N 1.33 0.52 0.00 4.70 2.02 -1.95 -2.57 112.91 116.97 2g0b h THR 165 Ca 0.38 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.46 2g0b h THR 165 Cb -0.10 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.51 2g0b h THR 165 CO -0.10 0.06 -1.19 0.52 0.37 0.00 0.00 175.52 175.18 2g0b n VAL 166 N -5.13 0.01 -3.86 3.16 0.31 -0.94 -4.43 118.33 107.45 2g0b n VAL 166 Ca 0.15 -0.11 -0.31 0.00 -0.01 0.00 0.00 64.34 64.06 2g0b n VAL 166 Cb 0.47 0.74 0.01 0.00 -0.91 0.00 0.00 33.84 34.15 2g0b n VAL 166 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2g0b n ASN 167 N -1.68 -2.82 -3.58 4.52 5.15 0.39 -0.35 115.26 116.89 2g0b n ASN 167 Ca 0.02 -1.05 -0.12 0.00 -0.60 0.00 0.00 54.58 52.83 2g0b n ASN 167 Cb 0.38 -2.99 -0.05 0.00 -0.53 0.00 0.00 39.78 36.60 2g0b n ASN 167 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2g0b s ALA 168 N -3.71 -1.20 0.64 5.20 0.00 -1.15 -4.71 121.76 116.83 2g0b s ALA 168 Ca 0.26 0.34 -0.16 0.00 0.00 0.00 0.00 51.96 52.39 2g0b s ALA 168 Cb -0.10 0.54 -0.01 0.00 0.00 0.00 0.00 23.12 23.55 2g0b s ALA 168 CO 0.89 -0.58 1.15 -2.14 0.00 0.00 0.00 175.76 175.08 2g0b s PRO 169 N -3.05 2.79 -0.12 0.00 0.02 -1.26 -1.08 135.00 132.29 2g0b s PRO 169 Ca -0.02 1.56 -0.17 0.00 0.02 0.00 0.00 61.00 62.39 2g0b s PRO 169 Cb 0.00 -1.93 0.04 0.00 0.02 0.00 0.00 34.50 32.63 2g0b s PRO 169 CO -0.07 -1.29 0.45 0.00 -0.33 0.00 0.00 177.00 175.76 2g0b s ALA 170 N -2.07 -1.12 0.15 -1.55 0.00 -0.39 -4.41 121.76 112.37 2g0b s ALA 170 Ca 0.71 1.05 0.09 0.00 0.00 0.00 0.00 51.96 53.80 2g0b s ALA 170 Cb -0.24 -0.45 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 2g0b s ALA 170 CO 0.38 -0.25 -0.13 0.96 0.00 0.00 0.00 175.76 176.73 2g0b s ILE 171 N -0.33 3.08 -0.18 0.00 -0.00 -0.94 -1.00 121.20 121.84 2g0b s ILE 171 Ca -0.05 -1.55 -0.09 0.00 -0.00 0.00 0.00 60.65 58.97 2g0b s ILE 171 Cb -0.03 -2.47 -0.05 0.00 -0.00 0.00 0.00 42.46 39.91 2g0b s ILE 171 CO 0.03 0.00 0.11 0.00 -0.00 0.00 0.00 174.94 175.08 2g0b s ALA 172 N -1.43 3.66 0.07 2.27 0.00 -1.17 -1.96 121.76 123.21 2g0b s ALA 172 Ca 0.22 -0.69 0.05 0.00 0.00 0.00 0.00 51.96 51.54 2g0b s ALA 172 Cb -0.10 -2.06 -0.03 0.00 0.00 0.00 0.00 23.12 20.93 2g0b s ALA 172 CO 0.13 0.27 -0.15 1.03 0.00 0.00 0.00 175.76 177.04 2g0b s ARG 173 N 0.05 0.86 0.06 0.00 0.52 0.08 -0.44 118.95 120.08 2g0b s ARG 173 Ca 0.09 -0.96 0.01 0.00 -0.52 0.00 0.00 55.73 54.34 2g0b s ARG 173 Cb -0.11 -0.89 -0.03 0.00 0.52 0.00 0.00 34.95 34.43 2g0b s ARG 173 CO -0.00 0.20 -0.05 0.00 0.02 0.00 0.00 175.30 175.47 2g0b s ALA 174 N -1.23 0.57 -0.05 2.13 0.00 0.12 0.01 121.76 123.32 2g0b s ALA 174 Ca -0.01 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 50.95 2g0b s ALA 174 Cb -0.10 0.16 0.02 0.00 0.00 0.00 0.00 23.12 23.20 2g0b s ALA 174 CO 0.02 -0.21 -0.08 -1.17 0.00 0.00 0.00 175.76 174.33 2g0b s LEU 175 N -2.34 1.52 -0.72 0.00 2.96 -0.55 -0.56 118.68 119.00 2g0b s LEU 175 Ca -0.00 -0.20 -0.27 0.00 -0.22 0.00 0.00 54.13 53.44 2g0b s LEU 175 Cb -0.01 -0.60 0.02 0.00 0.50 0.00 0.00 46.19 46.11 2g0b s LEU 175 CO -0.04 -0.00 1.36 -0.47 -1.32 0.00 0.00 176.35 175.87 2g0b s TYR 176 N 0.70 2.21 0.15 5.38 5.04 -1.26 -1.36 117.35 128.21 2g0b s TYR 176 Ca -0.11 0.08 -0.16 0.00 -2.44 0.00 0.00 57.07 54.44 2g0b s TYR 176 Cb -0.14 -4.55 0.02 0.00 0.35 0.00 0.00 41.96 37.64 2g0b s TYR 176 CO 0.02 -2.09 1.80 0.28 -1.34 0.00 0.00 175.55 174.21 2g0b h VAL 177 N 6.15 1.05 -0.52 3.14 2.07 -1.35 -2.90 116.25 123.90 2g0b h VAL 177 Ca -0.28 -0.16 0.15 0.00 0.82 0.00 0.00 66.70 67.23 2g0b h VAL 177 Cb 1.07 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 2g0b h VAL 177 CO 1.27 0.09 0.55 -0.65 0.02 0.00 0.00 177.57 178.85 2g0b h PRO 178 N 0.47 0.00 -1.98 1.57 0.11 -1.77 -2.12 132.00 128.27 2g0b h PRO 178 Ca 0.15 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.76 2g0b h PRO 178 Cb -0.01 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 30.70 2g0b h PRO 178 CO -0.06 0.00 -1.08 -0.85 -0.21 0.00 0.00 178.00 175.80 2g0b n GLU 179 N -3.68 1.47 0.17 1.05 0.28 -1.15 -4.95 120.64 113.83 2g0b n GLU 179 Ca 0.10 -3.68 0.04 0.00 -0.16 0.00 0.00 57.16 53.45 2g0b n GLU 179 Cb 0.76 -1.79 0.43 0.00 1.43 0.00 0.00 31.44 32.27 2g0b n GLU 179 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 177.13 177.08 2g0b h TRP 180 N 2.99 0.12 0.00 -1.84 5.08 -1.18 -2.81 115.95 118.30 2g0b h TRP 180 Ca 0.10 -0.01 0.00 0.00 1.08 0.00 0.00 58.89 60.05 2g0b h TRP 180 Cb 0.89 -0.03 0.00 0.00 -3.00 0.00 0.00 29.16 27.02 2g0b h TRP 180 CO 0.54 0.29 0.00 0.07 -1.28 0.00 0.00 178.44 178.06 2g0b h ARG 181 N 0.11 0.00 -0.02 0.12 0.11 -1.89 -2.63 114.38 110.18 2g0b h ARG 181 Ca 0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.10 2g0b h ARG 181 Cb 0.38 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.46 2g0b h ARG 181 CO 0.03 0.00 -0.03 -1.13 0.10 0.00 0.00 179.97 178.93 2g0b n SER 182 N -2.50 1.65 -0.15 0.08 3.41 -1.06 -3.91 113.62 111.14 2g0b n SER 182 Ca 0.02 -1.50 0.05 0.00 -0.26 0.00 0.00 58.87 57.18 2g0b n SER 182 Cb 0.29 0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.24 2g0b n SER 182 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2g0b n GLN 183 N 0.24 2.70 -5.30 4.33 6.02 -0.99 -5.00 117.38 119.37 2g0b n GLN 183 Ca 0.17 -0.39 -0.31 0.00 -0.01 0.00 0.00 57.00 56.46 2g0b n GLN 183 Cb 0.39 -1.04 -0.16 0.00 1.02 0.00 0.00 30.24 30.45 2g0b n GLN 183 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2g0b s THR 184 N -1.55 2.06 0.26 5.09 2.01 -1.23 -4.14 115.64 118.14 2g0b s THR 184 Ca 0.07 -1.11 0.07 0.00 0.31 0.00 0.00 61.69 61.03 2g0b s THR 184 Cb 0.08 -1.71 -0.02 0.00 0.01 0.00 0.00 72.50 70.86 2g0b s THR 184 CO 0.30 0.58 1.60 -0.07 -0.69 0.00 0.00 174.62 176.34 2g0b h LEU 185 N 5.48 0.14 -1.44 4.42 3.38 -1.90 -3.20 115.31 122.20 2g0b h LEU 185 Ca -0.43 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.46 2g0b h LEU 185 Cb 1.12 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2g0b h LEU 185 CO 0.47 0.70 0.00 -0.07 0.09 0.00 0.00 178.44 179.63 2g0b h LEU 186 N 0.10 0.00 -0.35 1.67 3.38 -1.94 -1.75 115.31 116.41 2g0b h LEU 186 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2g0b h LEU 186 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2g0b h LEU 186 CO 0.08 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.61 2g0b h ALA 187 N 2.04 1.00 0.00 1.53 0.00 -1.82 -2.80 119.26 119.21 2g0b h ALA 187 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2g0b h ALA 187 Cb 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2g0b h ALA 187 CO 0.00 0.00 -0.05 0.37 0.00 0.00 0.00 179.25 179.57 2g0b h GLN 188 N 0.00 0.00 -0.90 0.00 5.75 -1.54 -2.94 115.11 115.48 2g0b h GLN 188 Ca 0.00 0.00 -0.40 0.00 -0.15 0.00 0.00 58.65 58.10 2g0b h GLN 188 Cb 0.58 0.00 -0.24 0.00 1.07 0.00 0.00 27.48 28.89 2g0b h GLN 188 CO 0.00 0.05 0.50 1.19 -2.65 0.00 0.00 178.83 177.92 2g0b n PHE 189 N -3.23 2.84 -1.12 3.99 3.01 -1.05 -5.21 117.46 116.68 2g0b n PHE 189 Ca -0.01 -1.58 0.00 0.00 1.01 0.00 0.00 57.45 56.87 2g0b n PHE 189 Cb 0.26 -0.85 0.00 0.00 -0.01 0.00 0.00 39.48 38.88 2g0b n PHE 189 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77